N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide

C12H15ClN2O — CID 65188374

IUPACN-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide
SMILESNCC(NC(=O)c1ccccc1Cl)C1CC1
InChIInChI=1S/C12H15ClN2O/c13-10-4-2-1-3-9(10)12(16)15-11(7-14)8-5-6-8/h1-4,8,11H,5-7,14H2,(H,15,16)
InChIKeyGTPWPBCPNBQFHS-UHFFFAOYSA-N
MW238.72 g/mol
LogP1.81
Rot. Bonds4

About N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide

N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide (PubChem CID 65188374) has the molecular formula C12H15ClN2O and a molecular weight of 238.72 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide
PubChem CID65188374
Molecular FormulaC12H15ClN2O
Molecular Weight238.72 g/mol
Exact Mass238.09
IUPAC NameN-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide
SMILESNCC(NC(=O)c1ccccc1Cl)C1CC1
InChIInChI=1S/C12H15ClN2O/c13-10-4-2-1-3-9(10)12(16)15-11(7-14)8-5-6-8/h1-4,8,11H,5-7,14H2,(H,15,16)
InChIKeyGTPWPBCPNBQFHS-UHFFFAOYSA-N
XLogP1.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.72
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 81487183
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N-(2-amino-1-cyclopropylethyl)-2-methoxybenzamide
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CID 119614072
N-(2-amino-1-cyclopropylethyl)-3-(2-chlorophenyl)-1-methylpyrazole-4-carboxamide
CID 119617801
N-(2-amino-1-cyclopropylethyl)-2-nitrobenzamide
CID 65188581
N-(2-amino-1-cyclopropylethyl)-2-(trifluoromethyl)benzamide;hydrochloride
CID 86813170
N-(2-amino-1-cyclopropylethyl)-5-chloro-2-methylbenzamide
CID 82883177
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N-(2-amino-1-cyclopropylethyl)-2-ethoxybenzamide;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide (CID 65188374) is N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide is NCC(NC(=O)c1ccccc1Cl)C1CC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide?
The InChIKey is GTPWPBCPNBQFHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2O/c13-10-4-2-1-3-9(10)12(16)15-11(7-14)8-5-6-8/h1-4,8,11H,5-7,14H2,(H,15,16).
What are the key properties of N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide?
N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide has a molecular weight of 238.72 g/mol, XLogP of 1.81, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide is sourced from PubChem (CID 65188374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).